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2,6-Bis(4-methoxyphenyl)-1,4-dithiine
The title molecule, C(18)H(16)O(2)S(2), reveals crystallographic twofold rotation symmetry (with both S atoms lying on the axis) and one half-molecule defines an asymmetric unit. The dithiine ring is in a boat conformation. The aromatic ring and the C=C bond are nearly coplanar, with small torsion...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2014
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3998302/ https://www.ncbi.nlm.nih.gov/pubmed/24764863 http://dx.doi.org/10.1107/S1600536814000397 |
Sumario: | The title molecule, C(18)H(16)O(2)S(2), reveals crystallographic twofold rotation symmetry (with both S atoms lying on the axis) and one half-molecule defines an asymmetric unit. The dithiine ring is in a boat conformation. The aromatic ring and the C=C bond are nearly coplanar, with small torsion angles of −171.26 (19) and 8.5 (3)°. The two S—C bond lengths [1.7391 (19) and 1.7795 (18) Å] are shorter than single C—S bonds and longer than analogous C=S double bonds, which indicates a certain degree of conjugation between the lone pair on the S atom and π electrons of the C=C bond. The crystal packing only features van der Waals interactions. |
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